1,3-Dinitronaphthalene - CAS 606-37-1

Catalog:	BB030758
Product Name:	1,3-Dinitronaphthalene
CAS:	606-37-1
Synonyms:	1,3-dinitronaphthalene

Technical Data

Safety and Hazards

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Computed Properties

IUPAC Name:	1,3-dinitronaphthalene
Description:	1,3-Dinitronaphthalene (CAS# 606-37-1) is a useful research chemical.
Molecular Weight:	218.17
Molecular Formula:	C10H6N2O4
Canonical SMILES:	C1=CC=C2C(=C1)C=C(C=C2[N+](=O)[O-])[N+](=O)[O-]
InChI:	InChI=1S/C10H6N2O4/c13-11(14)8-5-7-3-1-2-4-9(7)10(6-8)12(15)16/h1-6H
InChI Key:	ULALSFRIGPMWRS-UHFFFAOYSA-N
Boiling Point:	377.211 °C at 760 mmHg
Melting Point:	146-148 °C (lit.)
Purity:	95 %
Density:	1.482 g/cm³
Appearance:	Beige powder.
MDL:	MFCD00003915
LogP:	3.70260

Publication Number	Title	Priority Date
CN-113184834-A	Nitrogen-doped graphene quantum dot, preparation thereof and application thereof in detecting hydrogen peroxide	20210428
CN-112992556-A	Preparation method and application of lithium ion capacitor pre-embedded lithium additive	20210206
WO-2020045242-A1	Pyrromethene boron complex, light emitting element using same, display device, lighting device, color conversion composition, color conversion film, color conversion substrate, light source unit and display	20180827
TW-202020110-A	Pyrrolomethylene boron complex, light-emitting element using the same, display device, lighting device, color conversion composition, color conversion film, color conversion substrate, light source unit and display	20180827
CN-112601754-A	Methylene pyrrole boron complex, and light-emitting element, display device, lighting device, color conversion composition, color conversion film, color conversion substrate, light source unit, and display using same	20180827

PMID	Publication Date	Title	Journal
19232672	20090501	Photocatalytic oxidation of dinitronaphthalenes: theory and experiment	Chemosphere
21202359	20080418	2,4-Dinitro-1-naphthyl 4-toluene-sulfonate	Acta crystallographica. Section E, Structure reports online

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Related Functional Groups

Nitrogen Compounds

[32894-07-8]
Benzyl thioacetimidate hydrochloride
[1243387-55-4]
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[13021-14-2]
2,4,6-Trimethyl-N-methylaniline
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[5071-96-5]
3-Methoxybenzylamine

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	296
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	218.03275668
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	218.03275668
Rotatable Bond Count:	0
Topological Polar Surface Area:	91.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8